[3-(pyridin-3-ylmethoxy)phenyl] 2-cyano-4-(2-methylphenyl)butaneperoxoate

Systemtic Name: [3-(pyridin-3-ylmethoxy)phenyl] 2-cyano-4-(2-methylphenyl)butaneperoxoate Openeye Name: [3-(3-pyridylmethoxy)phenyl] 2-cyano-4-(o-tolyl)butaneperoxoate CAS Name: 2-cyano-4-(2-methylphenyl)butaneperoxoic acid [3-(3-pyridinylmethoxy)phenyl] ester IUPAC Name: [3-(pyridin-3-ylmethoxy)phenyl] 2-cyano-4-(2-methylphenyl)butaneperoxoate Traditional Name: 2-cyano-4-(o-tolyl)peroxybutyric acid [3-(3-pyridylmethoxy)phenyl] ester Formula: C24H22N2O4 MolecularWeight: 402.44248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCC(C#N)C(=O)OOC2=CC=CC(=C2)OCC3=CN=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CCC(C#N)C(=O)OOC2=CC=CC(=C2)OCC3=CN=CC=C3

InChI

InChI=1S/C24H22N2O4/c1-18-6-2-3-8-20(18)11-12-21(15-25)24(27)30-29-23-10-4-9-22(14-23)28-17-19-7-5-13-26-16-19/h2-10,13-14,16,21H,11-12,17H2,1H3